4-methyl-5-(4-methylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-methyl-5-(4-methylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-methyl-5-(p-tolyl)-2-[[4-(3-thienylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-methyl-5-(4-methylphenyl)-2-[[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-5-(4-methylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-methyl-5-(p-tolyl)-2-[[4-(3-thenyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C20H25N5S2 MolecularWeight: 399.576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=S)N2C)CN3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=S)N2C)CN3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C20H25N5S2/c1-16-3-5-18(6-4-16)19-21-25(20(26)22(19)2)15-24-10-8-23(9-11-24)13-17-7-12-27-14-17/h3-7,12,14H,8-11,13,15H2,1-2H3